4-[(3-fluorophenoxy)methyl]piperidine

C12H16FNO — CID 17178045

IUPAC4-[(3-fluorophenoxy)methyl]piperidine
SMILESFc1cccc(OCC2CCNCC2)c1
InChIInChI=1S/C12H16FNO/c13-11-2-1-3-12(8-11)15-9-10-4-6-14-7-5-10/h1-3,8,10,14H,4-7,9H2
InChIKeyMCMLFCIYKDWAIW-UHFFFAOYSA-N
MW209.26 g/mol
LogP2.20
Rot. Bonds3

About 4-[(3-fluorophenoxy)methyl]piperidine

4-[(3-fluorophenoxy)methyl]piperidine (PubChem CID 17178045) has the molecular formula C12H16FNO and a molecular weight of 209.26 g/mol. Its IUPAC name is 4-[(3-fluorophenoxy)methyl]piperidine.

Molecular Properties

Compound Name4-[(3-fluorophenoxy)methyl]piperidine
PubChem CID17178045
Molecular FormulaC12H16FNO
Molecular Weight209.26 g/mol
Exact Mass209.12
IUPAC Name4-[(3-fluorophenoxy)methyl]piperidine
SMILESFc1cccc(OCC2CCNCC2)c1
InChIInChI=1S/C12H16FNO/c13-11-2-1-3-12(8-11)15-9-10-4-6-14-7-5-10/h1-3,8,10,14H,4-7,9H2
InChIKeyMCMLFCIYKDWAIW-UHFFFAOYSA-N
XLogP2.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.26
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(3-fluorophenoxy)methyl]piperidine?
The IUPAC name of 4-[(3-fluorophenoxy)methyl]piperidine (CID 17178045) is 4-[(3-fluorophenoxy)methyl]piperidine.
What is the SMILES notation for 4-[(3-fluorophenoxy)methyl]piperidine?
The canonical SMILES for 4-[(3-fluorophenoxy)methyl]piperidine is Fc1cccc(OCC2CCNCC2)c1.
What is the InChIKey of 4-[(3-fluorophenoxy)methyl]piperidine?
The InChIKey is MCMLFCIYKDWAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO/c13-11-2-1-3-12(8-11)15-9-10-4-6-14-7-5-10/h1-3,8,10,14H,4-7,9H2.
What are the key properties of 4-[(3-fluorophenoxy)methyl]piperidine?
4-[(3-fluorophenoxy)methyl]piperidine has a molecular weight of 209.26 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-fluorophenoxy)methyl]piperidine is sourced from PubChem (CID 17178045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).